3-cyclohexyl-2-[4-(2-fluorophenyl)phenyl]-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-2-[4-(2-fluorophenyl)phenyl]-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-2-[4-(2-fluorophenyl)phenyl]-1-(2-morpholino-2-oxo-ethyl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-2-[4-(2-fluorophenyl)phenyl]-1-[2-(4-morpholinyl)-2-oxoethyl]-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-2-[4-(2-fluorophenyl)phenyl]-1-(2-morpholin-4-yl-2-oxoethyl)indole-6-carboxylic acid Traditional Name: 3-cyclohexyl-2-[4-(2-fluorophenyl)phenyl]-1-(2-keto-2-morpholino-ethyl)indole-6-carboxylic acid Formula: C33H33FN2O4 MolecularWeight: 540.624523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCOCC4)C5=CC=C(C=C5)C6=CC=CC=C6F

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCOCC4)C5=CC=C(C=C5)C6=CC=CC=C6F

InChI

InChI=1S/C33H33FN2O4/c34-28-9-5-4-8-26(28)22-10-12-24(13-11-22)32-31(23-6-2-1-3-7-23)27-15-14-25(33(38)39)20-29(27)36(32)21-30(37)35-16-18-40-19-17-35/h4-5,8-15,20,23H,1-3,6-7,16-19,21H2,(H,38,39)